# generated using pymatgen data_Tb2(Ga3Ir)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.50339111 _cell_length_b 7.50339111 _cell_length_c 9.46909210 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.80324703 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2(Ga3Ir)3 _chemical_formula_sum 'Tb4 Ga18 Ir6' _cell_volume 462.60654087 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Tb Tb0 1 0.99787913 0.66921582 0.25000000 1.0 Tb Tb1 1 0.00212087 0.33078418 0.75000000 1.0 Tb Tb2 1 0.66921582 0.99787913 0.25000000 1.0 Tb Tb3 1 0.33078418 0.00212087 0.75000000 1.0 Ga Ga4 1 0.13014176 0.13014176 0.25000000 1.0 Ga Ga5 1 0.86985824 0.86985824 0.75000000 1.0 Ga Ga6 1 0.00109510 0.33448961 0.07856867 1.0 Ga Ga7 1 -0.00109510 0.66551039 0.92143133 1.0 Ga Ga8 1 -0.00109510 0.66551039 0.57856867 1.0 Ga Ga9 1 0.33448961 0.00109510 0.42143133 1.0 Ga Ga10 1 0.00109510 0.33448961 0.42143133 1.0 Ga Ga11 1 0.66551039 -0.00109510 0.57856867 1.0 Ga Ga12 1 0.66551039 -0.00109510 0.92143133 1.0 Ga Ga13 1 0.33448961 0.00109510 0.07856867 1.0 Ga Ga14 1 0.33383680 0.33383680 0.56637064 1.0 Ga Ga15 1 0.66616320 0.66616320 0.43362936 1.0 Ga Ga16 1 0.66616320 0.66616320 0.06637064 1.0 Ga Ga17 1 0.33383680 0.33383680 0.93362936 1.0 Ga Ga18 1 0.33809952 0.54427842 0.25000000 1.0 Ga Ga19 1 0.66190048 0.45572158 0.75000000 1.0 Ga Ga20 1 0.54427842 0.33809952 0.25000000 1.0 Ga Ga21 1 0.45572158 0.66190048 0.75000000 1.0 Ir Ir22 1 0.67135216 0.32864784 0.00000000 1.0 Ir Ir23 1 0.32864784 0.67135216 0.00000000 1.0 Ir Ir24 1 0.32864784 0.67135216 0.50000000 1.0 Ir Ir25 1 0.67135216 0.32864784 0.50000000 1.0 Ir Ir26 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir27 1 0.00000000 0.00000000 0.50000000 1.0